N,N-dimethyl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide

C14H22N2O4 — CID 43214462

IUPACN,N-dimethyl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide
SMILESCOc1ccc(CNCC(=O)N(C)C)c(OC)c1OC
InChIInChI=1S/C14H22N2O4/c1-16(2)12(17)9-15-8-10-6-7-11(18-3)14(20-5)13(10)19-4/h6-7,15H,8-9H2,1-5H3
InChIKeyMFVZTEUHKVSFEZ-UHFFFAOYSA-N
MW282.34 g/mol
LogP0.89
Rot. Bonds7

About N,N-dimethyl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide

N,N-dimethyl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide (PubChem CID 43214462) has the molecular formula C14H22N2O4 and a molecular weight of 282.34 g/mol. Its IUPAC name is N,N-dimethyl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide
PubChem CID43214462
Molecular FormulaC14H22N2O4
Molecular Weight282.34 g/mol
Exact Mass282.16
IUPAC NameN,N-dimethyl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide
SMILESCOc1ccc(CNCC(=O)N(C)C)c(OC)c1OC
InChIInChI=1S/C14H22N2O4/c1-16(2)12(17)9-15-8-10-6-7-11(18-3)14(20-5)13(10)19-4/h6-7,15H,8-9H2,1-5H3
InChIKeyMFVZTEUHKVSFEZ-UHFFFAOYSA-N
XLogP0.89
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-propan-2-yl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide
CID 43400025
2-[(2,4-dimethoxyphenyl)methylamino]-N,N-dimethylacetamide
CID 43214431
N-[(2,3,4-trimethoxyphenyl)methyl]acetamide
CID 18425632
N-cyclopropyl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide
CID 43430495
2-[(2,3,4-trimethoxyphenyl)methylamino]acetonitrile
CID 139371375
3-[(2,3,4-trimethoxyphenyl)methylamino]propanamide
CID 43553337
2-methyl-N-[(2,3,4-trimethoxyphenyl)methyl]propan-1-amine
CID 4719122
N'-[(2,3,4-trimethoxyphenyl)methyl]-N-[2-[(2,3,4-trimethoxyphenyl)methylamino]ethyl]ethane-1,2-diamine;trihydrochloride
CID 139593123
oxalic acid;1-phenyl-N-[(2,3,4-trimethoxyphenyl)methyl]methanamine
CID 17052977
4-[(2,3,4-trimethoxyphenyl)methylamino]butanoic acid
CID 60782759
N-[(2,3,4-trimethoxyphenyl)methyl]but-2-yn-1-amine
CID 115866344
1-[(2,4-dimethoxy-3-methylphenyl)methylamino]propan-2-one
CID 115234740

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide?
The IUPAC name of N,N-dimethyl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide (CID 43214462) is N,N-dimethyl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide.
What is the SMILES notation for N,N-dimethyl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide?
The canonical SMILES for N,N-dimethyl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide is COc1ccc(CNCC(=O)N(C)C)c(OC)c1OC.
What is the InChIKey of N,N-dimethyl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide?
The InChIKey is MFVZTEUHKVSFEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O4/c1-16(2)12(17)9-15-8-10-6-7-11(18-3)14(20-5)13(10)19-4/h6-7,15H,8-9H2,1-5H3.
What are the key properties of N,N-dimethyl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide?
N,N-dimethyl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide has a molecular weight of 282.34 g/mol, XLogP of 0.89, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[(2,3,4-trimethoxyphenyl)methylamino]acetamide is sourced from PubChem (CID 43214462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).